3-Hexanol, nitrate

Base Information

Chemical Name:3-Hexanol, nitrate
CAS No.:82944-60-3
Molecular Formula:C₆H₁₃NO₃
Molecular Weight:147.174
Hs Code.:
DSSTox Substance ID:DTXSID001003013
Mol file:82944-60-3.mol

Synonyms:3-Hexanol, nitrate;3-Hexyl nitrate;82944-60-3;hexan-3-yl nitrate;SCHEMBL8277384;OJOZCOXRANAOPV-UHFFFAOYSA-N;DTXSID001003013

Suppliers and Price of 3-Hexanol, nitrate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 4 raw suppliers

Chemical Property of 3-Hexanol, nitrate

Chemical Property:

Vapor Pressure:2.01mmHg at 25°C
Boiling Point:169.8°Cat760mmHg
Flash Point:56.1°C
PSA：55.05000
Density:1g/cm³
LogP:2.29660
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:147.08954328
Heavy Atom Count:10
Complexity:99.7

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(CC)O[N+](=O)[O-]

Technology Process of 3-Hexanol, nitrate

There total 4 articles about 3-Hexanol, nitrate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 110-54-3
hexane

: 108-24-7
acetic anhydride

: 5953-49-1
2-hexyl acetate

: 40780-64-1
(±)-3-hexyl acetate

: 21981-49-7
2-nitrooxy-hexane

: 82944-60-3
3-nitrooxy-hexane

Guidance literature:: With nitric acid; Further byproducts given. Title compound not separated from byproducts;

Reference yield:

: 110-54-3
hexane

: 20633-11-8
n-hexyl nitrate

: 21981-49-7
2-nitrooxy-hexane

: 82944-60-3
3-nitrooxy-hexane

Guidance literature:: With methyl nitrite; ultra-zero air; nitrogen(II) oxide; at 25.9 ℃; for 0.333333h; Product distribution; Rate constant; Irradiation; other alkyl peroxy radical generator (Cl₂);
DOI:10.1021/j100220a022

Reference yield:

: 110-54-3
hexane

: 21981-49-7
2-nitrooxy-hexane

: 646-14-0
1-nitrohexane

: 14255-44-8
2-Hexyl nitrate

: 82944-60-3
3-nitrooxy-hexane

Guidance literature:: With N-hydroxyphthalimide; air; Nitrogen dioxide; at 70 ℃; for 14h; under 760 Torr; Further byproducts given. Title compound not separated from byproducts;
DOI:10.1002/1521-3773(20010105)40:1<222::AID-ANIE222>3.0.CO;2-W